Geometry & MOs

Info

ID:	88760
PubChem CID:	49956529
Reduced:	Cl2N2F3C11H13 (1)
Stoich.:	A2B2C3D11E13 (1)
Weight, g/mol:	379.156577
ΔH_f, kcal/mol:	-9.13
Dipole, Da:	58.2
IP(EA), eV:	-5.06(-5.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-2-cyano-3-[4-(dipropylsulfamoyl)anilino]prop-2-enoate

Drug info:

PubChemData

Smile

C1CCN(C1)C2=C(C=C(C=C2)N)C(F)(F)F.[Cl-].[Cl-]

DOS

IR

Vibrations